TL;DR: A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- (CAS 1038-19-3) is a chemical compound with molecular formula C20H30O2 and molecular weight 302.22458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,6S)-2-ethynyl-3a,5a-dimethyl-3,3b,4,5,6,7,8,8a,8b,9,10,10a-dodecahydro-1H-indeno[5,4-e]indene-2,6-diol
Also Known As: A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL-, 2-beta,17-beta-Dihydroxy-2-alpha-ethinyl-A-nor(5-alpha)androstane, 7-Ethynyl-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol, (1S,7R)-7-ethynyl-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol, (2R,6S)-2-ethynyl-3a,5a-dimethyl-3,3b,4,5,6,7,8,8a,8b,9,10,10a-dodecahydro-1H-indeno[5,4-e]indene-2,6-diol
| Molecular Formula | C20H30O2 |
| Molecular Weight | 302.22458 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.22458 Da |
| Heavy Atoms | 22 |
| Complexity | 533.0 |
| SMILES | CC12CCC3C(C1CC[C@@H]2O)CCC4C3(C[C@](C4)(C#C)O)C |
| InChIKey | KSJJQCZCDJYYDJ-RZOQUZGISA-N |
The XLogP value of 3.7 indicates that A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- is 1038-19-3.
The molecular formula of A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- is C20H30O2.
The molecular weight of A-NOR-5-alpha-ANDROSTANE-2-beta,17-beta-DIOL, 2-alpha-ETHYNYL- is 302.22458 g/mol.
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